Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 9/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.37 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.34 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NR2C2 | P49116 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | TAB1 | Q15750 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4103534 | 1.00 | HRH4 (0.38) | HRH4KDM4EALDH1A1NPSR1CXCR4 | |
| SCHEMBL4122189 | 0.89 | HRH4 (0.39) | HRH4KDM4EALDH1A1NPSR1CXCR4 | |
| SCHEMBL4110343 | 0.88 | CXCR4 (0.40) | HRH4CXCR4ACACBMAPK8ALK | |
| SCHEMBL4105651 | 0.88 | CXCR4 (0.40) | HRH4CXCR4ACACBMAPK8ALK | |
| SCHEMBL4116420 | 0.86 | CXCR4 (0.43) | HRH4CXCR4MRGPRX1ALK | |
| SCHEMBL4116258 | 0.85 | CXCR4 (0.40) | HRH4CXCR4ACACBMRGPRX1MAPK8 | |
| SCHEMBL4110044 | 0.85 | CXCR4 (0.40) | HRH4CXCR4ACACBMRGPRX1MAPK8 | |
| SCHEMBL13696571 | 0.84 | HRH4 (0.40) | HRH4CXCR4ALK | |
| SCHEMBL4111574 | 0.84 | CXCR4 (0.39) | HRH4CXCR4ACACBMRGPRX1MAPK8 | |
| SCHEMBL2006649 | 0.84 | CXCR4 (0.39) | HRH4CXCR4ACACBMRGPRX1MAPK8 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1852432-A1 | NITROGENOUS HETEROCYCLIC COMPOUND AND MEDICINAL USE THEREOF | ONO PHARMACEUTICAL CO., LTD. (JP) | 2007-11-07 | — | — | EP | disclosed |